[2-oxidanylidene-2-[(2-phenoxyphenyl)amino]ethyl] 4-(cyclopropylamino)-3-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[(2-phenoxyphenyl)amino]ethyl] 4-(cyclopropylamino)-3-nitro-benzoate Openeye Name: [2-oxo-2-(2-phenoxyanilino)ethyl] 4-(cyclopropylamino)-3-nitro-benzoate CAS Name: 4-(cyclopropylamino)-3-nitrobenzoic acid [2-oxo-2-(2-phenoxyanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenoxyanilino)ethyl] 4-(cyclopropylamino)-3-nitrobenzoate Traditional Name: 4-(cyclopropylamino)-3-nitro-benzoic acid [2-keto-2-(2-phenoxyanilino)ethyl] ester Formula: C24H21N3O6 MolecularWeight: 447.44004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=CC=C3OC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=CC=C3OC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N3O6/c28-23(26-20-8-4-5-9-22(20)33-18-6-2-1-3-7-18)15-32-24(29)16-10-13-19(25-17-11-12-17)21(14-16)27(30)31/h1-10,13-14,17,25H,11-12,15H2,(H,26,28)